ethyl 1-[3-(4-tert-butylbenzamido)-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzoyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-(4-tert-butylbenzamido)-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzoyl]piperidine-4-carboxylate
ethyl 1-[3-(4-tert-butylbenzamido)-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzoyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | K781-0343 |
| Compound Name: | ethyl 1-[3-(4-tert-butylbenzamido)-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzoyl]piperidine-4-carboxylate |
| Molecular Weight: | 624.78 |
| Molecular Formula: | C37 H44 N4 O5 |
| Smiles: | CCOC(C1CCN(CC1)C(c1ccc(c(c1)NC(c1ccc(cc1)C(C)(C)C)=O)N1CC2CC(C1)C1=CC=CC(N1C2)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.9465 |
| logD: | 5.8985 |
| logSw: | -5.445 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.884 |
| InChI Key: | IEIXEEHDVDXBID-UHFFFAOYSA-N |